Química Física

2002

1. 3,5-Difluorobenzonitrile: Ab initio calculations, FTIR and Raman spectra

   Spectrochimica Acta - Part A Molecular and Biomolecular Spectroscopy, Vol. 58, Núm. 9, pp. 1987-2004

2. A Monte Carlo study of the influence of molecular flexibility on the phase diagram of a fused hard sphere model

   Journal of Chemical Physics, Vol. 117, Núm. 22, pp. 10370-10379

3. A computer simulation study of racemic mixtures

   Molecular Physics, Vol. 100, Núm. 15, pp. 2397-2415

4. A non-equilibrium molecular dynamics approach to fluid transfer through microporous membranes

   Molecular Physics, Vol. 100, Núm. 14, pp. 2337-2349

5. A quasiclassical trajectory and quantum mechanical study of the O(1D) + D2 reaction dynamics. Comparison with high resolution molecular beam experiments

   Physical Chemistry Chemical Physics, Vol. 4, Núm. 18, pp. 4379-4385

6. A quasiclassical trajectory study of the H + H2O → OH + H2 reaction dynamics at 1.4 eV collision energy on a new ab initio potential energy surface

   Chemical Physics Letters, Vol. 356, Núm. 1-2, pp. 120-126

7. A technique and a method for the continuous, simultaneous, and automatic measurement of density and speed of sound in pure liquids and solutions

   Review of Scientific Instruments, Vol. 73, Núm. 2 I, pp. 416

8. Accurate scaling of the vibrational spectra of aniline and several derivatives

   Journal of Molecular Structure: THEOCHEM, Vol. 593, Núm. 1-3, pp. 101-131

9. Advances in reaction dynamics by digital imaging of product luminescence

   Recent. Res. Develop. Chem. Phys., Vol. 3, pp. 1-17

10. CO2-Tea, mid-infrared, laser-based dial system: Featuring ozone dynamics during a "vehicle-free" day

    Instrumentation Science and Technology, Vol. 30, Núm. 4, pp. 427-438

11. Capillary waves in ionic surfactant solutions: Effects of the electrostatic adsorption barrier and analysis in terms of a new dispersion equation

    Journal of Physical Chemistry B, Vol. 106, Núm. 22, pp. 5636-5644

12. Carbohydrate-water interactions of p-nitrophenylglycosides in aqueous solution. Ultrasonic and densitometric studies

    Physical Chemistry Chemical Physics, Vol. 4, Núm. 2, pp. 352-357

13. Critical lines and phase coexistence of polymer solutions: A quantitative comparison between Wertheim's thermodynamic perturbation theory and computer simulations

    Journal of Chemical Physics, Vol. 117, Núm. 13, pp. 6360-6371

14. Cyclization kinetics of nondiluted bond fluctuation chains

    Macromolecules, Vol. 35, Núm. 14, pp. 5681-5687

15. Dielectric study of the dynamics of poly(oxyethylene) chains in triblock copolymers: Poly(oxyethylene)-b-polystyrene-b-poly(oxyethylene)

    Macromolecules, Vol. 35, Núm. 14, pp. 5483-5490

16. Dilational rheology of monolayers of a miscible polymer blend: From good- to poor-solvent conditions

    European Physical Journal E, Vol. 9, Núm. 4, pp. 375-385

17. Dilution effect of the feed on yield of olefins during catalytic cracking of vacuum gas oil

    Applied Catalysis A: General, Vol. 230, Núm. 1-2, pp. 111-125

18. Dynamics of bond-fluctuation model chains in good and theta solvents

    Macromolecular Theory and Simulations, Vol. 11, Núm. 2, pp. 171-183

19. Effect of Pressure on Hydrogen Bonding in Liquid Methanol

    Physical Review Letters, Vol. 89, Núm. 19

20. Energy dependence of forward scattering in the differential cross section of the H+D2→ HD(v′ = 3,j′ = 0) + D reaction

    Journal of Chemical Physics, Vol. 117, Núm. 6, pp. 2546